COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL411737
Chemical Name: (3,4-dimethoxyphenyl){4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}methanone
Smiles: COc1ccc(cc1OC)C(=O)N1CCN(CC1)c1ccc(c(c1)n1nc(cc1C)C)[N+](=O)[O-]

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Molecular Weight: 465.51
Empirical Formula: C24H27N5O5

Physical State: Dry powder
Available Amount: 31 mg

Lipinsky:
logP: 4.444
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 105
Number of rings: 4

     

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